%chk=000274075.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274075

0 1
S -1.578655 2.163429 -1.451135
O -0.820145 3.185306 -2.126545
O -2.952515 1.947998 -1.855391
N -0.725701 0.650682 -1.539343
N 0.805257 -0.423455 0.082474
C -0.587338 -0.012617 -0.198144
C -0.944330 1.085960 0.827608
C -1.459414 2.269807 0.270793
C -1.531284 -1.205771 -0.020764
C -0.978846 -0.211910 -2.712585
C -0.782178 0.961313 2.202620
C -1.812386 3.339442 1.078655
C -2.906515 -1.025017 -0.247053
C -1.058836 -2.462663 0.376933
C -1.143267 2.043402 3.021998
C -1.652379 3.220978 2.469234
C 1.809349 -0.072377 -0.652956
C -3.791446 -2.091801 -0.080798
C -1.949691 -3.529052 0.542087
C -3.315543 -3.347131 0.313901
C 3.177542 -0.511823 -0.285838
C 4.259093 -0.044579 -1.054241
C 3.417921 -1.373220 0.796552
C 5.561524 -0.437514 -0.740913
C 4.723949 -1.763942 1.104697
C 5.795798 -1.297898 0.337826
H -0.423192 -1.161488 -2.626616
H -0.615397 0.306504 -3.618399
H -2.047398 -0.459215 -2.851705
H -0.376113 0.043169 2.629770
H -2.208080 4.262630 0.650501
H -3.299992 -0.052974 -0.561455
H 0.005517 -2.619882 0.565514
H -1.021803 1.959592 4.103309
H -1.926692 4.052979 3.116509
H 1.753481 0.550173 -1.567058
H -4.855588 -1.943177 -0.260272
H -1.573323 -4.502975 0.850328
H -4.007759 -4.177185 0.442579
H 4.085127 0.627443 -1.894451
H 2.579459 -1.733264 1.396595
H 6.396598 -0.072965 -1.337182
H 4.905275 -2.432270 1.944948
H 6.812819 -1.603043 0.579313


%chk=000274075-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274075

0 1
S -1.571999 2.181205 -1.536003
O -0.687962 3.299491 -2.310892
O -3.137666 2.033537 -1.986897
N -0.682524 0.547561 -1.528784
N 0.774692 -0.557278 0.147672
C -0.607067 -0.083644 -0.177436
C -0.929041 1.041217 0.829929
C -1.397192 2.257606 0.321758
C -1.603283 -1.257807 -0.008903
C -0.908160 -0.270524 -2.734848
C -0.769921 0.922449 2.227672
C -1.716012 3.376693 1.103212
C -2.978143 -1.040907 -0.287119
C -1.171840 -2.537640 0.411101
C -1.083843 2.025022 3.053311
C -1.550710 3.245109 2.501246
C 1.789133 -0.118277 -0.548176
C -3.906600 -2.092179 -0.135118
C -2.104544 -3.590879 0.556361
C -3.474372 -3.371627 0.288634
C 3.179606 -0.501357 -0.236633
C 4.230025 0.006528 -1.048131
C 3.495851 -1.360376 0.852953
C 5.572452 -0.336654 -0.778805
C 4.835385 -1.701710 1.120434
C 5.877782 -1.191788 0.305370
H -0.161250 -1.084592 -2.738486
H -0.736158 0.355363 -3.627494
H -1.919138 -0.716615 -2.788843
H -0.402753 -0.017249 2.650428
H -2.074968 4.307171 0.653272
H -3.326596 -0.059046 -0.634327
H -0.110613 -2.692268 0.624471
H -0.962248 1.936620 4.138041
H -1.785855 4.089615 3.157051
H 1.634869 0.569818 -1.402694
H -4.965707 -1.913729 -0.351947
H -1.760555 -4.579854 0.880133
H -4.197497 -4.186721 0.405206
H 3.989371 0.672324 -1.886325
H 2.677427 -1.741071 1.472770
H 6.376237 0.059954 -1.408352
H 5.074991 -2.362668 1.960832
H 6.919301 -1.459222 0.516255


